N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide

C14H21N5O2 — CID 163352589

IUPACN-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide
SMILESCN(C)c1ccnc(N2CCOC(C(=O)NC3CC3)C2)n1
InChIInChI=1S/C14H21N5O2/c1-18(2)12-5-6-15-14(17-12)19-7-8-21-11(9-19)13(20)16-10-3-4-10/h5-6,10-11H,3-4,7-9H2,1-2H3,(H,16,20)
InChIKeyGICJLQQFXYRMGK-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.03
Rot. Bonds4

About N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide

N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide (PubChem CID 163352589) has the molecular formula C14H21N5O2 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide
PubChem CID163352589
Molecular FormulaC14H21N5O2
Molecular Weight291.35 g/mol
Exact Mass291.17
IUPAC NameN-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide
SMILESCN(C)c1ccnc(N2CCOC(C(=O)NC3CC3)C2)n1
InChIInChI=1S/C14H21N5O2/c1-18(2)12-5-6-15-14(17-12)19-7-8-21-11(9-19)13(20)16-10-3-4-10/h5-6,10-11H,3-4,7-9H2,1-2H3,(H,16,20)
InChIKeyGICJLQQFXYRMGK-UHFFFAOYSA-N
XLogP0.03
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide?
The IUPAC name of N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide (CID 163352589) is N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide is CN(C)c1ccnc(N2CCOC(C(=O)NC3CC3)C2)n1.
What is the InChIKey of N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide?
The InChIKey is GICJLQQFXYRMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c1-18(2)12-5-6-15-14(17-12)19-7-8-21-11(9-19)13(20)16-10-3-4-10/h5-6,10-11H,3-4,7-9H2,1-2H3,(H,16,20).
What are the key properties of N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide?
N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 0.03, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[4-(dimethylamino)pyrimidin-2-yl]morpholine-2-carboxamide is sourced from PubChem (CID 163352589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).