3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride

C16H31Cl2N3O2 — CID 119830190

IUPAC3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride
SMILESCC(C)(CNC(=O)C1C2CCC(C2)C1N)N1CCOCC1.Cl.Cl
InChIInChI=1S/C16H29N3O2.2ClH/c1-16(2,19-5-7-21-8-6-19)10-18-15(20)13-11-3-4-12(9-11)14(13)17;;/h11-14H,3-10,17H2,1-2H3,(H,18,20);2*1H
InChIKeySYERQKVTNHGSKD-UHFFFAOYSA-N
MW368.35 g/mol
LogP1.43
Rot. Bonds4

About 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride

3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride (PubChem CID 119830190) has the molecular formula C16H31Cl2N3O2 and a molecular weight of 368.35 g/mol. Its IUPAC name is 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride.

Molecular Properties

Compound Name3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride
PubChem CID119830190
Molecular FormulaC16H31Cl2N3O2
Molecular Weight368.35 g/mol
Exact Mass367.18
IUPAC Name3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride
SMILESCC(C)(CNC(=O)C1C2CCC(C2)C1N)N1CCOCC1.Cl.Cl
InChIInChI=1S/C16H29N3O2.2ClH/c1-16(2,19-5-7-21-8-6-19)10-18-15(20)13-11-3-4-12(9-11)14(13)17;;/h11-14H,3-10,17H2,1-2H3,(H,18,20);2*1H
InChIKeySYERQKVTNHGSKD-UHFFFAOYSA-N
XLogP1.43
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.35
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride with MolForge

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Related Compounds

N-(2-methyl-2-morpholin-4-ylpropyl)adamantane-2-carboxamide
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3-amino-N-(3-methyl-2-morpholin-4-ylbutyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 119841278
3-amino-N-(2,2,4-trimethylpentyl)bicyclo[2.2.1]heptane-2-carboxamide
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3-amino-N-(2-hydroxy-2-methylpentyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 106292057
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CID 120796944
2,2-dimethyl-3-[(2-methyl-2-morpholin-4-ylpropyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 64835014
2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
CID 62490413
2-methyl-1-(2-methyl-2-morpholin-4-ylpropyl)guanidine
CID 110913680
3-amino-N-[[1-(morpholin-4-ylmethyl)cyclohexyl]methyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119896456
3-amino-N-(2-amino-2-oxoethyl)bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119726704
3-amino-N-[3-(tert-butylamino)-3-oxopropyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride?
The IUPAC name of 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride (CID 119830190) is 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride.
What is the SMILES notation for 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride?
The canonical SMILES for 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride is CC(C)(CNC(=O)C1C2CCC(C2)C1N)N1CCOCC1.Cl.Cl.
What is the InChIKey of 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride?
The InChIKey is SYERQKVTNHGSKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O2.2ClH/c1-16(2,19-5-7-21-8-6-19)10-18-15(20)13-11-3-4-12(9-11)14(13)17;;/h11-14H,3-10,17H2,1-2H3,(H,18,20);2*1H.
What are the key properties of 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride?
3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride has a molecular weight of 368.35 g/mol, XLogP of 1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methyl-2-morpholin-4-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119830190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).