3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide

C14H24N2O — CID 113266414

IUPAC3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide
SMILESCC(CNC(=O)C1C2CCC(C2)C1N)C1CC1
InChIInChI=1S/C14H24N2O/c1-8(9-2-3-9)7-16-14(17)12-10-4-5-11(6-10)13(12)15/h8-13H,2-7,15H2,1H3,(H,16,17)
InChIKeyRTUKAOPCEVJRAK-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.52
Rot. Bonds4

About 3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide

3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 113266414) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide
PubChem CID113266414
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide
SMILESCC(CNC(=O)C1C2CCC(C2)C1N)C1CC1
InChIInChI=1S/C14H24N2O/c1-8(9-2-3-9)7-16-14(17)12-10-4-5-11(6-10)13(12)15/h8-13H,2-7,15H2,1H3,(H,16,17)
InChIKeyRTUKAOPCEVJRAK-UHFFFAOYSA-N
XLogP1.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(2-cyclohexyl-2-hydroxyethyl)bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119731702
3-amino-N-(2,2,4-trimethylpentyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 119820248
3-amino-N-[2-oxo-2-(propan-2-ylamino)ethyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119692045
3-amino-N-[(1-propan-2-ylcyclopropyl)methyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 113267120
3-amino-N-[2-(2-hydroxyethyl)pentyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 106116632
3-amino-N-(3-methyl-2-morpholin-4-ylbutyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 119841278
3-amino-N-(1-cyclopropylpropan-2-yl)bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119784586
3-amino-N-[2-(4-methoxyphenoxy)propyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119725350
3-amino-N-(2-amino-2-oxoethyl)bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119726704
3-amino-N-(2-methyl-3-thiophen-2-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 119804174
3-amino-N-carbamoylbicyclo[2.2.1]heptane-2-carboxamide
CID 79194327
3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 103809511

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of 3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide (CID 113266414) is 3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for 3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide is CC(CNC(=O)C1C2CCC(C2)C1N)C1CC1.
What is the InChIKey of 3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is RTUKAOPCEVJRAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-8(9-2-3-9)7-16-14(17)12-10-4-5-11(6-10)13(12)15/h8-13H,2-7,15H2,1H3,(H,16,17).
What are the key properties of 3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide?
3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 236.36 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-cyclopropylpropyl)bicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 113266414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).