N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride

C8H16ClN3O — CID 68536512

IUPACN-piperazin-1-ylcyclopropanecarboxamide;hydrochloride
SMILESCl.O=C(NN1CCNCC1)C1CC1
InChIInChI=1S/C8H15N3O.ClH/c12-8(7-1-2-7)10-11-5-3-9-4-6-11;/h7,9H,1-6H2,(H,10,12);1H
InChIKeyVWCRQPVNPIRPKT-UHFFFAOYSA-N
MW205.69 g/mol
LogP-0.25
Rot. Bonds2

About N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride

N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride (PubChem CID 68536512) has the molecular formula C8H16ClN3O and a molecular weight of 205.69 g/mol. Its IUPAC name is N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride.

Molecular Properties

Compound NameN-piperazin-1-ylcyclopropanecarboxamide;hydrochloride
PubChem CID68536512
Molecular FormulaC8H16ClN3O
Molecular Weight205.69 g/mol
Exact Mass205.10
IUPAC NameN-piperazin-1-ylcyclopropanecarboxamide;hydrochloride
SMILESCl.O=C(NN1CCNCC1)C1CC1
InChIInChI=1S/C8H15N3O.ClH/c12-8(7-1-2-7)10-11-5-3-9-4-6-11;/h7,9H,1-6H2,(H,10,12);1H
InChIKeyVWCRQPVNPIRPKT-UHFFFAOYSA-N
XLogP-0.25
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.69
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylpiperazin-1-yl)cyclopropanecarboxamide
CID 567398
N-piperazin-1-ylbutanamide
CID 54039259
2-methyl-N-piperazin-1-ylpropanamide
CID 58682974
3-methyl-N-piperazin-1-ylbutanamide
CID 126578161
3,3-dimethyl-N-piperazin-1-ylbutanamide
CID 166132083
N-piperazin-1-ylbutanamide;zinc
CID 175211680
calcium;hydride;N-piperazin-1-ylbutanamide
CID 175217940
N-(4-methylpiperazin-4-ium-1-yl)cyclopropanecarboxamide
CID 7213284
N-piperazin-1-ylcyclopropanecarboxamide
CID 53273957
4-[4-(Cyclopropylmethyl)piperazin-1-yl]butanehydrazide
CID 63579698
2-(cyclopropylmethylamino)-N-piperidin-1-ylacetamide
CID 83022069

Frequently Asked Questions

What is the IUPAC name of N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride?
The IUPAC name of N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride (CID 68536512) is N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride.
What is the SMILES notation for N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride?
The canonical SMILES for N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride is Cl.O=C(NN1CCNCC1)C1CC1.
What is the InChIKey of N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride?
The InChIKey is VWCRQPVNPIRPKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O.ClH/c12-8(7-1-2-7)10-11-5-3-9-4-6-11;/h7,9H,1-6H2,(H,10,12);1H.
What are the key properties of N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride?
N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride has a molecular weight of 205.69 g/mol, XLogP of -0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperazin-1-ylcyclopropanecarboxamide;hydrochloride is sourced from PubChem (CID 68536512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).