N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide

C16H27N3O — CID 60807268

IUPACN-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide
SMILESCCCN(C(=O)c1cccn1CCC)C1CCNCC1
InChIInChI=1S/C16H27N3O/c1-3-11-18-13-5-6-15(18)16(20)19(12-4-2)14-7-9-17-10-8-14/h5-6,13-14,17H,3-4,7-12H2,1-2H3
InChIKeyZCQGCOYBPMMIAP-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.50
Rot. Bonds6

About N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide

N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide (PubChem CID 60807268) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide
PubChem CID60807268
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC NameN-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide
SMILESCCCN(C(=O)c1cccn1CCC)C1CCNCC1
InChIInChI=1S/C16H27N3O/c1-3-11-18-13-5-6-15(18)16(20)19(12-4-2)14-7-9-17-10-8-14/h5-6,13-14,17H,3-4,7-12H2,1-2H3
InChIKeyZCQGCOYBPMMIAP-UHFFFAOYSA-N
XLogP2.50
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-propyl-N-pyrrolidin-3-yl-1-(2,2,2-trifluoroethyl)pyrrole-2-carboxamide
CID 114610258
N-(8-azabicyclo[3.2.1]octan-3-yl)-1-ethyl-N-propylpyrrole-2-carboxamide
CID 61232091
1-methyl-2-oxo-N-piperidin-4-yl-N-propylpyridine-4-carboxamide
CID 103813162
4-acetyl-1-methyl-N-piperidin-4-yl-N-propylpyrrole-2-carboxamide
CID 119823974
N-piperidin-4-yl-N-propyl-4-pyrazol-1-ylbenzamide;hydrochloride
CID 119824042
2-[2-[butyl(cyclopropyl)carbamoyl]pyrrol-1-yl]acetic acid
CID 79324945
2-chloro-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119826015
N-piperidin-4-yl-N-propylpyridine-4-carboxamide
CID 54923494
3-[piperidin-4-yl(propyl)carbamoyl]benzoic acid
CID 61408528
N-piperidin-4-yl-N-propylnaphthalene-1-carboxamide
CID 119824426
1-methyl-4-nitro-N-piperidin-4-yl-N-propylpyrrole-2-carboxamide
CID 60805753
piperazin-1-yl-(1-propylpyrrol-2-yl)methanone
CID 43639000

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide?
The IUPAC name of N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide (CID 60807268) is N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide.
What is the SMILES notation for N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide?
The canonical SMILES for N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide is CCCN(C(=O)c1cccn1CCC)C1CCNCC1.
What is the InChIKey of N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide?
The InChIKey is ZCQGCOYBPMMIAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-3-11-18-13-5-6-15(18)16(20)19(12-4-2)14-7-9-17-10-8-14/h5-6,13-14,17H,3-4,7-12H2,1-2H3.
What are the key properties of N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide?
N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide has a molecular weight of 277.41 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yl-N,1-dipropylpyrrole-2-carboxamide is sourced from PubChem (CID 60807268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).