N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide

C19H29N5O2 — CID 53165784

IUPACN-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide
SMILESO=C(NC1CCCC1)C1CCN(c2cncnc2N2CCOCC2)CC1
InChIInChI=1S/C19H29N5O2/c25-19(22-16-3-1-2-4-16)15-5-7-23(8-6-15)17-13-20-14-21-18(17)24-9-11-26-12-10-24/h13-16H,1-12H2,(H,22,25)
InChIKeyXGCCKQWDNLYREQ-UHFFFAOYSA-N
MW359.47 g/mol
LogP1.59
Rot. Bonds4

About N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide

N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide (PubChem CID 53165784) has the molecular formula C19H29N5O2 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide
PubChem CID53165784
Molecular FormulaC19H29N5O2
Molecular Weight359.47 g/mol
Exact Mass359.23
IUPAC NameN-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide
SMILESO=C(NC1CCCC1)C1CCN(c2cncnc2N2CCOCC2)CC1
InChIInChI=1S/C19H29N5O2/c25-19(22-16-3-1-2-4-16)15-5-7-23(8-6-15)17-13-20-14-21-18(17)24-9-11-26-12-10-24/h13-16H,1-12H2,(H,22,25)
InChIKeyXGCCKQWDNLYREQ-UHFFFAOYSA-N
XLogP1.59
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide (CID 53165784) is N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide is O=C(NC1CCCC1)C1CCN(c2cncnc2N2CCOCC2)CC1.
What is the InChIKey of N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide?
The InChIKey is XGCCKQWDNLYREQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N5O2/c25-19(22-16-3-1-2-4-16)15-5-7-23(8-6-15)17-13-20-14-21-18(17)24-9-11-26-12-10-24/h13-16H,1-12H2,(H,22,25).
What are the key properties of N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide?
N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(4-morpholin-4-ylpyrimidin-5-yl)piperidine-4-carboxamide is sourced from PubChem (CID 53165784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).