4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide

C11H22N4O — CID 61462070

IUPAC4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide
SMILESCN1CCC(NC2CCN(C(N)=O)CC2)C1
InChIInChI=1S/C11H22N4O/c1-14-5-2-10(8-14)13-9-3-6-15(7-4-9)11(12)16/h9-10,13H,2-8H2,1H3,(H2,12,16)
InChIKeyZXBLDUXBVJIXJM-UHFFFAOYSA-N
MW226.32 g/mol
LogP-0.18
Rot. Bonds2

About 4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide

4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide (PubChem CID 61462070) has the molecular formula C11H22N4O and a molecular weight of 226.32 g/mol. Its IUPAC name is 4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide
PubChem CID61462070
Molecular FormulaC11H22N4O
Molecular Weight226.32 g/mol
Exact Mass226.18
IUPAC Name4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide
SMILESCN1CCC(NC2CCN(C(N)=O)CC2)C1
InChIInChI=1S/C11H22N4O/c1-14-5-2-10(8-14)13-9-3-6-15(7-4-9)11(12)16/h9-10,13H,2-8H2,1H3,(H2,12,16)
InChIKeyZXBLDUXBVJIXJM-UHFFFAOYSA-N
XLogP-0.18
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methylamino)piperidine-1-carboxamide
CID 43754889
4-[(1-cyclopropylpiperidin-4-yl)amino]piperidine-1-carboxamide
CID 43791337
4-[[1-(cyclopropanecarbonyl)piperidin-4-yl]amino]piperidine-1-carboxamide
CID 43791478
4-[(3-ethylcyclohexyl)amino]piperidine-1-carboxamide
CID 64742206
3-(cyclopentylamino)piperidine-1-carboxamide
CID 83999864
4-(thiolan-3-ylamino)piperidine-1-carboxamide
CID 103783659
4-[(3-methoxycyclopentyl)amino]piperidine-1-carboxamide
CID 103081793
1-methyl-N-(oxan-4-yl)pyrrolidin-3-amine
CID 61462196
2-methyl-1-[4-[(1-methylpiperidin-4-yl)amino]piperidin-1-yl]propan-1-one
CID 43747773
ethyl 4-[(1-carbamoylpiperidin-4-yl)amino]cyclohexane-1-carboxylate
CID 60933460
1-methyl-N-(oxetan-3-yl)pyrrolidin-3-amine
CID 63623290
4-[(3-ethylsulfanylcyclopentyl)amino]piperidine-1-carboxamide
CID 103787245

Frequently Asked Questions

What is the IUPAC name of 4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide?
The IUPAC name of 4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide (CID 61462070) is 4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide.
What is the SMILES notation for 4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide?
The canonical SMILES for 4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide is CN1CCC(NC2CCN(C(N)=O)CC2)C1.
What is the InChIKey of 4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide?
The InChIKey is ZXBLDUXBVJIXJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O/c1-14-5-2-10(8-14)13-9-3-6-15(7-4-9)11(12)16/h9-10,13H,2-8H2,1H3,(H2,12,16).
What are the key properties of 4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide?
4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide has a molecular weight of 226.32 g/mol, XLogP of -0.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methylpyrrolidin-3-yl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 61462070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).