1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide

C19H27N3O3 — CID 72928865

IUPAC1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
SMILESCOCCN(Cc1ccncc1)C(=O)C1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C19H27N3O3/c1-25-13-12-22(14-15-4-8-20-9-5-15)19(24)17-6-10-21(11-7-17)18(23)16-2-3-16/h4-5,8-9,16-17H,2-3,6-7,10-14H2,1H3
InChIKeySCLISXFRMQINKK-UHFFFAOYSA-N
MW345.44 g/mol
LogP1.71
Rot. Bonds7

About 1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide

1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide (PubChem CID 72928865) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is 1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
PubChem CID72928865
Molecular FormulaC19H27N3O3
Molecular Weight345.44 g/mol
Exact Mass345.21
IUPAC Name1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide
SMILESCOCCN(Cc1ccncc1)C(=O)C1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C19H27N3O3/c1-25-13-12-22(14-15-4-8-20-9-5-15)19(24)17-6-10-21(11-7-17)18(23)16-2-3-16/h4-5,8-9,16-17H,2-3,6-7,10-14H2,1H3
InChIKeySCLISXFRMQINKK-UHFFFAOYSA-N
XLogP1.71
TPSA62.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-Pyridinecarboxamide, N,N-bis(2-hydroxyethyl)-
CID 116925
1-(2-methoxyethyl)-N-[(3-methyl-2-pyridinyl)methyl]-6-oxopiperidine-3-carboxamide
CID 24819416
N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 654022
(4-Benzylpiperidin-1-yl)(1-(pyridin-4-ylmethyl)piperidin-4-yl)methanone
CID 49864753
4-[(3-Methyl-1-piperidinyl)carbonyl]pyridine
CID 2931707
2-Methoxy-1-[9-(pyridin-4-ylmethyl)-3,9-diazaspiro[5.5]undecan-3-yl]ethanone
CID 3234412
N-(3-Morpholin-4-yl-propyl)-N-pyridin-4-ylmethyl-acetamide
CID 9549613
(4-Methylpiperazin-1-yl)(1-(pyridin-4-ylmethyl)piperidin-4-yl)methanone
CID 49864752
4-Isonicotinoyl-2,6-dimethylmorpholine
CID 2970570
N-butyl-N-methyl-1-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 3151173
1-(morpholin-4-ylsulfonyl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 3240216
3-methyl-N-[2-(4-pyridinyl)ethyl]butanamide
CID 934804

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide (CID 72928865) is 1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide is COCCN(Cc1ccncc1)C(=O)C1CCN(C(=O)C2CC2)CC1.
What is the InChIKey of 1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide?
The InChIKey is SCLISXFRMQINKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3/c1-25-13-12-22(14-15-4-8-20-9-5-15)19(24)17-6-10-21(11-7-17)18(23)16-2-3-16/h4-5,8-9,16-17H,2-3,6-7,10-14H2,1H3.
What are the key properties of 1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide?
1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide has a molecular weight of 345.44 g/mol, XLogP of 1.71, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropanecarbonyl)-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 72928865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).