cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone

C14H26N2O — CID 43747885

IUPACcyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone
SMILESCC(C)C(C)NC1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C14H26N2O/c1-10(2)11(3)15-13-6-8-16(9-7-13)14(17)12-4-5-12/h10-13,15H,4-9H2,1-3H3
InChIKeyLHKWWJXWJYNGSR-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.02
Rot. Bonds4

About cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone

cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone (PubChem CID 43747885) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone
PubChem CID43747885
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Namecyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone
SMILESCC(C)C(C)NC1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C14H26N2O/c1-10(2)11(3)15-13-6-8-16(9-7-13)14(17)12-4-5-12/h10-13,15H,4-9H2,1-3H3
InChIKeyLHKWWJXWJYNGSR-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclopropyl-[4-(3-methoxybutan-2-ylamino)piperidin-1-yl]methanone
CID 115709034
1-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]ethanone
CID 43223288
cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone
CID 60817866
cyclopropyl-[4-(pentan-3-ylamino)piperidin-1-yl]methanone
CID 43747893
ethyl 4-(3-methylbutan-2-ylamino)piperidine-1-carboxylate
CID 43196751
(2S)-2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3,3-dimethylbutanamide
CID 61179355
cyclopentyl-[4-(methylamino)piperidin-1-yl]methanone
CID 60820118
[4-[1-(4-bromophenyl)ethylamino]piperidin-1-yl]-cyclopropylmethanone
CID 43747865
2-(butan-2-ylamino)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]acetamide
CID 60853761
cyclopropyl-[4-(prop-2-ynylamino)piperidin-1-yl]methanone
CID 63952287
cyclopropyl-[4-[1-(5-methylthiophen-2-yl)ethylamino]piperidin-1-yl]methanone
CID 43747882
1-cyclopropyl-N-(3-methylbutan-2-yl)piperidin-4-amine
CID 43747064

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone (CID 43747885) is cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone is CC(C)C(C)NC1CCN(C(=O)C2CC2)CC1.
What is the InChIKey of cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone?
The InChIKey is LHKWWJXWJYNGSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-10(2)11(3)15-13-6-8-16(9-7-13)14(17)12-4-5-12/h10-13,15H,4-9H2,1-3H3.
What are the key properties of cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone?
cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone has a molecular weight of 238.37 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[4-(3-methylbutan-2-ylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 43747885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).