N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride

C9H17ClN2O — CID 53256498

IUPACN-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride
SMILESCl.O=C(N[C@@H]1CCCNC1)C1CC1
InChIInChI=1S/C9H16N2O.ClH/c12-9(7-3-4-7)11-8-2-1-5-10-6-8;/h7-8,10H,1-6H2,(H,11,12);1H/t8-;/m1./s1
InChIKeyMIJYVUATUVKQKX-DDWIOCJRSA-N
MW204.70 g/mol
LogP0.69
Rot. Bonds2

About N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride

N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride (PubChem CID 53256498) has the molecular formula C9H17ClN2O and a molecular weight of 204.70 g/mol. Its IUPAC name is N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride.

Molecular Properties

Compound NameN-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride
PubChem CID53256498
Molecular FormulaC9H17ClN2O
Molecular Weight204.70 g/mol
Exact Mass204.10
IUPAC NameN-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride
SMILESCl.O=C(N[C@@H]1CCCNC1)C1CC1
InChIInChI=1S/C9H16N2O.ClH/c12-9(7-3-4-7)11-8-2-1-5-10-6-8;/h7-8,10H,1-6H2,(H,11,12);1H/t8-;/m1./s1
InChIKeyMIJYVUATUVKQKX-DDWIOCJRSA-N
XLogP0.69
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.70
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride?
The IUPAC name of N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride (CID 53256498) is N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride.
What is the SMILES notation for N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride?
The canonical SMILES for N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride is Cl.O=C(N[C@@H]1CCCNC1)C1CC1.
What is the InChIKey of N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride?
The InChIKey is MIJYVUATUVKQKX-DDWIOCJRSA-N. The full InChI is InChI=1S/C9H16N2O.ClH/c12-9(7-3-4-7)11-8-2-1-5-10-6-8;/h7-8,10H,1-6H2,(H,11,12);1H/t8-;/m1./s1.
What are the key properties of N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride?
N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride has a molecular weight of 204.70 g/mol, XLogP of 0.69, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-piperidin-3-yl]cyclopropanecarboxamide;hydrochloride is sourced from PubChem (CID 53256498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).