4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine

C15H21N5 — CID 115530998

IUPAC4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine
SMILESCCCNC(Cc1ccnc(N)c1)c1ccnc(C)n1
InChIInChI=1S/C15H21N5/c1-3-6-18-14(13-5-8-17-11(2)20-13)9-12-4-7-19-15(16)10-12/h4-5,7-8,10,14,18H,3,6,9H2,1-2H3,(H2,16,19)
InChIKeyKNYDNMLRIWZRFQ-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.05
Rot. Bonds6

About 4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine

4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine (PubChem CID 115530998) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine
PubChem CID115530998
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine
SMILESCCCNC(Cc1ccnc(N)c1)c1ccnc(C)n1
InChIInChI=1S/C15H21N5/c1-3-6-18-14(13-5-8-17-11(2)20-13)9-12-4-7-19-15(16)10-12/h4-5,7-8,10,14,18H,3,6,9H2,1-2H3,(H2,16,19)
InChIKeyKNYDNMLRIWZRFQ-UHFFFAOYSA-N
XLogP2.05
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(5-bromo-3-pyridinyl)-1-(2-methylpyrimidin-4-yl)ethyl]propan-1-amine
CID 104803750
4-[2-(2-methylfuran-3-yl)-2-(propylamino)ethyl]pyridin-2-amine
CID 104790403
N-[2-(3-bromo-5-fluorophenyl)-1-(2-methylpyrimidin-4-yl)ethyl]propan-1-amine
CID 115531001
4-[2-(2-fluoro-5-methylphenyl)-2-(propylamino)ethyl]pyridin-2-amine
CID 107931764
4-(2-amino-4-pyridinyl)-1-N,1-N-diethyl-3-N-propylbutane-1,3-diamine
CID 79093708
N-[1-(2-methylpyrimidin-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 115531098
N-[2-(4-chloro-2-fluorophenyl)-1-(2-methylpyrimidin-4-yl)ethyl]propan-1-amine
CID 114856789
1-(2-methylpyrimidin-4-yl)-4-methylsulfonyl-N-propylbutan-1-amine
CID 115530977
4-[3-propan-2-ylsulfanyl-2-(propylamino)propyl]pyridin-2-amine
CID 65132138
N-ethyl-2-(4-iodophenyl)-1-(2-methylpyrimidin-4-yl)ethanamine
CID 115530719
4-[3-ethoxy-2-(propylamino)butyl]pyridin-2-amine
CID 64533806
4-[3-methoxy-2-(propylamino)hexyl]pyridin-2-amine
CID 116719566

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine?
The IUPAC name of 4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine (CID 115530998) is 4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine.
What is the SMILES notation for 4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine?
The canonical SMILES for 4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine is CCCNC(Cc1ccnc(N)c1)c1ccnc(C)n1.
What is the InChIKey of 4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine?
The InChIKey is KNYDNMLRIWZRFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-3-6-18-14(13-5-8-17-11(2)20-13)9-12-4-7-19-15(16)10-12/h4-5,7-8,10,14,18H,3,6,9H2,1-2H3,(H2,16,19).
What are the key properties of 4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine?
4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine has a molecular weight of 271.37 g/mol, XLogP of 2.05, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methylpyrimidin-4-yl)-2-(propylamino)ethyl]pyridin-2-amine is sourced from PubChem (CID 115530998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).