[4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone

C16H28N2O — CID 119623579

IUPAC[4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone
SMILESCCC1(C)CC1C(=O)N1CCC(NCC2CC2)CC1
InChIInChI=1S/C16H28N2O/c1-3-16(2)10-14(16)15(19)18-8-6-13(7-9-18)17-11-12-4-5-12/h12-14,17H,3-11H2,1-2H3
InChIKeySREPCSQZHHOAMC-UHFFFAOYSA-N
MW264.41 g/mol
LogP2.41
Rot. Bonds5

About [4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone

[4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone (PubChem CID 119623579) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is [4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone.

Molecular Properties

Compound Name[4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone
PubChem CID119623579
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name[4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone
SMILESCCC1(C)CC1C(=O)N1CCC(NCC2CC2)CC1
InChIInChI=1S/C16H28N2O/c1-3-16(2)10-14(16)15(19)18-8-6-13(7-9-18)17-11-12-4-5-12/h12-14,17H,3-11H2,1-2H3
InChIKeySREPCSQZHHOAMC-UHFFFAOYSA-N
XLogP2.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-ethyl-2-methylcyclopropyl)-[4-(methylamino)piperidin-1-yl]methanone
CID 119561939
(4-aminopiperidin-1-yl)-(2-ethyl-2-methylcyclopropyl)methanone
CID 119374903
[4-(cyclopropylmethylamino)piperidin-1-yl]-(2,2-dimethylcyclohexyl)methanone
CID 107181008
cyclopropyl-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone
CID 43747911
[4-(cyclopropylmethylamino)piperidin-1-yl]-(1-methylcyclopropyl)methanone
CID 119622236
cycloheptyl-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone
CID 81483591
cyclopent-3-en-1-yl-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone
CID 113283403
(3-aminopiperidin-1-yl)-(2-ethyl-2-methylcyclopropyl)methanone
CID 119379514
(4-butylcyclohexyl)-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone;hydrochloride
CID 119624610
4-(cyclopropylmethylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 115307162
1-[4-[(4-hydroxycyclohexyl)methylamino]piperidin-1-yl]ethanone
CID 114146739
[4-(cyclopropylmethylamino)piperidin-1-yl]-(thian-2-yl)methanone
CID 115307101

Frequently Asked Questions

What is the IUPAC name of [4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone?
The IUPAC name of [4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone (CID 119623579) is [4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone.
What is the SMILES notation for [4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone?
The canonical SMILES for [4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone is CCC1(C)CC1C(=O)N1CCC(NCC2CC2)CC1.
What is the InChIKey of [4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone?
The InChIKey is SREPCSQZHHOAMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-3-16(2)10-14(16)15(19)18-8-6-13(7-9-18)17-11-12-4-5-12/h12-14,17H,3-11H2,1-2H3.
What are the key properties of [4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone?
[4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone has a molecular weight of 264.41 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(cyclopropylmethylamino)piperidin-1-yl]-(2-ethyl-2-methylcyclopropyl)methanone is sourced from PubChem (CID 119623579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).