N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine

C14H19N3O — CID 135112400

IUPACN-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine
SMILESCCCc1cnc(C)nc1N(C)Cc1ccoc1
InChIInChI=1S/C14H19N3O/c1-4-5-13-8-15-11(2)16-14(13)17(3)9-12-6-7-18-10-12/h6-8,10H,4-5,9H2,1-3H3
InChIKeyGDOGVUAEHOXVOH-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.97
Rot. Bonds5

About N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine

N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine (PubChem CID 135112400) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine
PubChem CID135112400
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC NameN-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine
SMILESCCCc1cnc(C)nc1N(C)Cc1ccoc1
InChIInChI=1S/C14H19N3O/c1-4-5-13-8-15-11(2)16-14(13)17(3)9-12-6-7-18-10-12/h6-8,10H,4-5,9H2,1-3H3
InChIKeyGDOGVUAEHOXVOH-UHFFFAOYSA-N
XLogP2.97
TPSA42.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[furan-3-ylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol
CID 83184280
3-bromo-N-(furan-3-ylmethyl)-N,4-dimethylpyridin-2-amine
CID 106876742
5-bromo-2-chloro-N-(furan-3-ylmethyl)-N-methylpyrimidin-4-amine
CID 79075785
6-chloro-N-(furan-3-ylmethyl)-N,5-dimethylpyrimidin-4-amine
CID 63729632
2-ethyl-4-N-(furan-3-ylmethyl)-4-N,6-N,5-trimethylpyrimidine-4,6-diamine
CID 80987787
3-(2-aminoethyl)-N-(furan-3-ylmethyl)-N-methylimidazo[1,2-a]pyridin-2-amine
CID 63786700
N-(furan-3-ylmethyl)-N,3-dimethyl-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 80630765
5-(2-aminopropyl)-N-(furan-3-ylmethyl)-N,3-dimethylpyridin-2-amine
CID 80634374
[5-chloro-6-[furan-3-ylmethyl(methyl)amino]-3-pyridinyl]methanol
CID 61422350
2-chloro-N-(furan-3-ylmethyl)-N,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 103320853
5-[(tert-butylamino)methyl]-N-(furan-3-ylmethyl)-N,2-dimethylpyridin-4-amine
CID 81249115
3-[furan-3-ylmethyl(methyl)amino]pyrazine-2-carboxylic acid
CID 55107661

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine?
The IUPAC name of N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine (CID 135112400) is N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine.
What is the SMILES notation for N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine?
The canonical SMILES for N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine is CCCc1cnc(C)nc1N(C)Cc1ccoc1.
What is the InChIKey of N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine?
The InChIKey is GDOGVUAEHOXVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-4-5-13-8-15-11(2)16-14(13)17(3)9-12-6-7-18-10-12/h6-8,10H,4-5,9H2,1-3H3.
What are the key properties of N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine?
N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine has a molecular weight of 245.33 g/mol, XLogP of 2.97, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-N,2-dimethyl-5-propylpyrimidin-4-amine is sourced from PubChem (CID 135112400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).