N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide

C19H30N2OS — CID 74340203

IUPACN-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide
SMILESO=C(CCc1cccs1)NC1CCCCC1CN1CCCCC1
InChIInChI=1S/C19H30N2OS/c22-19(11-10-17-8-6-14-23-17)20-18-9-3-2-7-16(18)15-21-12-4-1-5-13-21/h6,8,14,16,18H,1-5,7,9-13,15H2,(H,20,22)
InChIKeyRBBDKTAWJSTSFC-UHFFFAOYSA-N
MW334.53 g/mol
LogP3.84
Rot. Bonds6

About N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide

N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide (PubChem CID 74340203) has the molecular formula C19H30N2OS and a molecular weight of 334.53 g/mol. Its IUPAC name is N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide.

Molecular Properties

Compound NameN-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide
PubChem CID74340203
Molecular FormulaC19H30N2OS
Molecular Weight334.53 g/mol
Exact Mass334.21
IUPAC NameN-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide
SMILESO=C(CCc1cccs1)NC1CCCCC1CN1CCCCC1
InChIInChI=1S/C19H30N2OS/c22-19(11-10-17-8-6-14-23-17)20-18-9-3-2-7-16(18)15-21-12-4-1-5-13-21/h6,8,14,16,18H,1-5,7,9-13,15H2,(H,20,22)
InChIKeyRBBDKTAWJSTSFC-UHFFFAOYSA-N
XLogP3.84
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.53
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxycyclohexyl)-3-thiophen-2-ylpropanamide
CID 55064170
3-(2-chlorophenyl)-N-[2-(piperidin-1-ylmethyl)cyclohexyl]propanamide
CID 74340181
N-[2-(chloromethyl)cyclohexyl]-4-thiophen-2-ylbutanamide
CID 106366998
N-[2-(hydroxymethyl)cyclopentyl]-4-thiophen-2-ylbutanamide
CID 103751345
3-cyclopentyl-N-[2-(piperidin-1-ylmethyl)cyclohexyl]propanamide
CID 74340536
N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-3-thiophen-2-ylpropanamide
CID 110819982
2-(4-chlorophenyl)-N-[2-(piperidin-1-ylmethyl)cyclohexyl]acetamide
CID 74340123
3-methyl-N-[2-(piperidin-1-ylmethyl)cyclohexyl]thiophene-2-carboxamide
CID 140519163
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-thiophen-2-ylpropanamide
CID 134047770
N-(2-aminocyclohexyl)-2-thiophen-2-ylacetamide
CID 19750865
N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]thiophene-3-carboxamide
CID 24871869
N-(1-propan-2-ylpiperidin-4-yl)-3-thiophen-2-ylpropanamide
CID 110751959

Frequently Asked Questions

What is the IUPAC name of N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide?
The IUPAC name of N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide (CID 74340203) is N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide.
What is the SMILES notation for N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide?
The canonical SMILES for N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide is O=C(CCc1cccs1)NC1CCCCC1CN1CCCCC1.
What is the InChIKey of N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide?
The InChIKey is RBBDKTAWJSTSFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2OS/c22-19(11-10-17-8-6-14-23-17)20-18-9-3-2-7-16(18)15-21-12-4-1-5-13-21/h6,8,14,16,18H,1-5,7,9-13,15H2,(H,20,22).
What are the key properties of N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide?
N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide has a molecular weight of 334.53 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(piperidin-1-ylmethyl)cyclohexyl]-3-thiophen-2-ylpropanamide is sourced from PubChem (CID 74340203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).