N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide

C11H20N2O2 — CID 106180519

IUPACN-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide
SMILESCOCC(CN)NC(=O)C1C2CCCC21
InChIInChI=1S/C11H20N2O2/c1-15-6-7(5-12)13-11(14)10-8-3-2-4-9(8)10/h7-10H,2-6,12H2,1H3,(H,13,14)
InChIKeyQQFARAZYKGMTAW-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.12
Rot. Bonds5

About N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide

N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide (PubChem CID 106180519) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide.

Molecular Properties

Compound NameN-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide
PubChem CID106180519
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide
SMILESCOCC(CN)NC(=O)C1C2CCCC21
InChIInChI=1S/C11H20N2O2/c1-15-6-7(5-12)13-11(14)10-8-3-2-4-9(8)10/h7-10H,2-6,12H2,1H3,(H,13,14)
InChIKeyQQFARAZYKGMTAW-UHFFFAOYSA-N
XLogP0.12
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Rel-(9AR,13AS)-1-(cyclopropylcarbonyl)dodecahydro-5,1,8-benzoxadiazacycloundecin-9(6H)-one
CID 110202315
Rel-(9AR,13AS)-1-(cyclopentylcarbonyl)dodecahydro-5,1,8-benzoxadiazacycloundecin-9(6H)-one
CID 110202323
N-(cyclopropylmethyl)-1-(2-methoxyethylamino)cyclopentane-1-carboxamide
CID 75378125
N-[(2S)-1-amino-3-methoxy-1-oxopropan-2-yl]cyclopentanecarboxamide
CID 97062029
N-(1-amino-3-methoxypropan-2-yl)-4-(trifluoromethyl)cyclohexane-1-carboxamide
CID 106180190
N-(1-amino-3-methoxypropan-2-yl)-2-(trifluoromethyl)cyclohexane-1-carboxamide
CID 106180523
N-(1-amino-3-methoxypropan-2-yl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 106180781
4,4-difluoro-N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclohexane-1-carboxamide
CID 106611480
N-(1-amino-3-methoxypropan-2-yl)-4,4-difluorocyclohexane-1-carboxamide
CID 114154777
2-cyclopentyl-N-(1-methoxypropan-2-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide?
The IUPAC name of N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide (CID 106180519) is N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide.
What is the SMILES notation for N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide?
The canonical SMILES for N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide is COCC(CN)NC(=O)C1C2CCCC21.
What is the InChIKey of N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide?
The InChIKey is QQFARAZYKGMTAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-15-6-7(5-12)13-11(14)10-8-3-2-4-9(8)10/h7-10H,2-6,12H2,1H3,(H,13,14).
What are the key properties of N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide?
N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide has a molecular weight of 212.29 g/mol, XLogP of 0.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide is sourced from PubChem (CID 106180519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).