N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide

C21H30N4O3 — CID 20925367

IUPACN-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2ncnc(N3CCOCC3)c2c1C(=O)N(C(C)C)C1CCCCC1
InChIInChI=1S/C21H30N4O3/c1-14(2)25(16-7-5-4-6-8-16)21(26)17-15(3)28-20-18(17)19(22-13-23-20)24-9-11-27-12-10-24/h13-14,16H,4-12H2,1-3H3
InChIKeyGSOLUEQASYPLMP-UHFFFAOYSA-N
MW386.50 g/mol
LogP3.55
Rot. Bonds4

About N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide

N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide (PubChem CID 20925367) has the molecular formula C21H30N4O3 and a molecular weight of 386.50 g/mol. Its IUPAC name is N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide
PubChem CID20925367
Molecular FormulaC21H30N4O3
Molecular Weight386.50 g/mol
Exact Mass386.23
IUPAC NameN-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide
SMILESCc1oc2ncnc(N3CCOCC3)c2c1C(=O)N(C(C)C)C1CCCCC1
InChIInChI=1S/C21H30N4O3/c1-14(2)25(16-7-5-4-6-8-16)21(26)17-15(3)28-20-18(17)19(22-13-23-20)24-9-11-27-12-10-24/h13-14,16H,4-12H2,1-3H3
InChIKeyGSOLUEQASYPLMP-UHFFFAOYSA-N
XLogP3.55
TPSA71.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide?
The IUPAC name of N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide (CID 20925367) is N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide.
What is the SMILES notation for N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide?
The canonical SMILES for N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide is Cc1oc2ncnc(N3CCOCC3)c2c1C(=O)N(C(C)C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide?
The InChIKey is GSOLUEQASYPLMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O3/c1-14(2)25(16-7-5-4-6-8-16)21(26)17-15(3)28-20-18(17)19(22-13-23-20)24-9-11-27-12-10-24/h13-14,16H,4-12H2,1-3H3.
What are the key properties of N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide?
N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide has a molecular weight of 386.50 g/mol, XLogP of 3.55, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-methyl-4-morpholin-4-yl-N-propan-2-ylfuro[2,3-d]pyrimidine-5-carboxamide is sourced from PubChem (CID 20925367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).