1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine

C16H18N4O — CID 103278561

IUPAC1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine
SMILESNC1CCN(c2ncc3c(n2)-c2ccccc2OC3)CC1
InChIInChI=1S/C16H18N4O/c17-12-5-7-20(8-6-12)16-18-9-11-10-21-14-4-2-1-3-13(14)15(11)19-16/h1-4,9,12H,5-8,10,17H2
InChIKeyNFVBSXMNBWBNMF-UHFFFAOYSA-N
MW282.35 g/mol
LogP1.96
Rot. Bonds1

About 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine

1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine (PubChem CID 103278561) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine
PubChem CID103278561
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine
SMILESNC1CCN(c2ncc3c(n2)-c2ccccc2OC3)CC1
InChIInChI=1S/C16H18N4O/c17-12-5-7-20(8-6-12)16-18-9-11-10-21-14-4-2-1-3-13(14)15(11)19-16/h1-4,9,12H,5-8,10,17H2
InChIKeyNFVBSXMNBWBNMF-UHFFFAOYSA-N
XLogP1.96
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(8-methyl-5H-indeno[1,2-d]pyrimidin-2-yl)piperidin-4-amine
CID 103278636
1-(4-methyl-5-phenylpyrimidin-2-yl)piperidin-4-amine
CID 103278594
1-[5-(2-methylphenyl)pyrimidin-2-yl]piperidin-4-amine
CID 117224077
1-(6,8-dimethyl-5,6,7,8-tetrahydroquinazolin-2-yl)piperidin-4-amine
CID 103278607
3-chloro-5H-chromeno[4,3-b]pyridine
CID 15748939
1-(6,6-dioxo-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-2-yl)piperidin-4-amine
CID 103278632
1-(8,8-dimethyl-6,7-dihydro-5H-quinazolin-2-yl)piperidin-4-amine
CID 103278609
[1-(5H-thiochromeno[4,3-d]pyrimidin-2-yl)pyrrolidin-2-yl]methanamine
CID 103279221
2-[5-(4-aminopiperidin-1-yl)-2-methylpyrimidin-4-yl]phenol
CID 136934488
1-(6-propan-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)piperidin-4-amine
CID 103278645
1-(6-tert-butyl-5,6,7,8-tetrahydroquinazolin-2-yl)piperidin-4-amine
CID 103278643
1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine
CID 103278668

Frequently Asked Questions

What is the IUPAC name of 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine?
The IUPAC name of 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine (CID 103278561) is 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine.
What is the SMILES notation for 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine?
The canonical SMILES for 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine is NC1CCN(c2ncc3c(n2)-c2ccccc2OC3)CC1.
What is the InChIKey of 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine?
The InChIKey is NFVBSXMNBWBNMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c17-12-5-7-20(8-6-12)16-18-9-11-10-21-14-4-2-1-3-13(14)15(11)19-16/h1-4,9,12H,5-8,10,17H2.
What are the key properties of 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine?
1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine has a molecular weight of 282.35 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5H-chromeno[4,3-d]pyrimidin-2-yl)piperidin-4-amine is sourced from PubChem (CID 103278561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).