6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine

C15H26N4 — CID 106619805

IUPAC6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
SMILESCCCN(CC1CCCN1)c1cc(C(C)C)ncn1
InChIInChI=1S/C15H26N4/c1-4-8-19(10-13-6-5-7-16-13)15-9-14(12(2)3)17-11-18-15/h9,11-13,16H,4-8,10H2,1-3H3
InChIKeyQCNDMHFSUPZDLL-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.57
Rot. Bonds6

About 6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine

6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine (PubChem CID 106619805) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
PubChem CID106619805
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
SMILESCCCN(CC1CCCN1)c1cc(C(C)C)ncn1
InChIInChI=1S/C15H26N4/c1-4-8-19(10-13-6-5-7-16-13)15-9-14(12(2)3)17-11-18-15/h9,11-13,16H,4-8,10H2,1-3H3
InChIKeyQCNDMHFSUPZDLL-UHFFFAOYSA-N
XLogP2.57
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-propan-2-yloxy-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106619278
N-(2-chloroethyl)-6-propan-2-yl-N-propylpyrimidin-4-amine
CID 63392292
N-(2-methylpropyl)-6-propoxy-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106620729
5,6-dimethyl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrazin-2-amine
CID 106619724
4-[piperidin-2-ylmethyl(propyl)amino]-1H-pyrimidin-6-one
CID 136805325
6-ethoxy-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106620572
N-(2-methylpropyl)-6-methylsulfanyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106973354
6-methoxy-5-methyl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106619899
N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
CID 106619840
N-(piperidin-2-ylmethyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 106642582
N-propyl-N-(pyrrolidin-2-ylmethyl)pyrido[2,3-b]pyrazin-6-amine
CID 106619672
2-[piperidin-2-ylmethyl(propyl)amino]pyridine-4-carboxamide
CID 106642290

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine (CID 106619805) is 6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine is CCCN(CC1CCCN1)c1cc(C(C)C)ncn1.
What is the InChIKey of 6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine?
The InChIKey is QCNDMHFSUPZDLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-4-8-19(10-13-6-5-7-16-13)15-9-14(12(2)3)17-11-18-15/h9,11-13,16H,4-8,10H2,1-3H3.
What are the key properties of 6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine?
6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine has a molecular weight of 262.40 g/mol, XLogP of 2.57, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 106619805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).