6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine

C10H15ClN4 — CID 130791788

IUPAC6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine
SMILESCN(C)C1(CNc2cc(Cl)ncn2)CC1
InChIInChI=1S/C10H15ClN4/c1-15(2)10(3-4-10)6-12-9-5-8(11)13-7-14-9/h5,7H,3-4,6H2,1-2H3,(H,12,13,14)
InChIKeyRNCVMIHBBSXXBT-UHFFFAOYSA-N
MW226.71 g/mol
LogP1.64
Rot. Bonds4

About 6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine

6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine (PubChem CID 130791788) has the molecular formula C10H15ClN4 and a molecular weight of 226.71 g/mol. Its IUPAC name is 6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine
PubChem CID130791788
Molecular FormulaC10H15ClN4
Molecular Weight226.71 g/mol
Exact Mass226.10
IUPAC Name6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine
SMILESCN(C)C1(CNc2cc(Cl)ncn2)CC1
InChIInChI=1S/C10H15ClN4/c1-15(2)10(3-4-10)6-12-9-5-8(11)13-7-14-9/h5,7H,3-4,6H2,1-2H3,(H,12,13,14)
InChIKeyRNCVMIHBBSXXBT-UHFFFAOYSA-N
XLogP1.64
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(dimethylamino)cyclopentyl]methyl]-6-methylsulfanylpyrimidin-4-amine
CID 106972972
[1-[[(6-chloropyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 115361870
2-tert-butyl-6-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]pyrimidin-4-amine
CID 83113055
N-(6-chloropyrimidin-4-yl)-N',N'-dimethylpropane-1,3-diamine;hydrochloride
CID 56832156
6-chloro-2-N-[[1-(dimethylamino)cyclopentyl]methyl]pyridine-2,4-diamine
CID 104923863
2-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]pyrimidin-4-amine
CID 80703179
2-N-[[1-(dimethylamino)cyclopentyl]methyl]pyridine-2,4-diamine
CID 83116516
6-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]-5-methylpyrimidin-4-amine
CID 83113894
6-ethoxy-N-[(1-methylcyclopropyl)methyl]pyrimidin-4-amine
CID 104917819
6-chloro-N-(6-chloropyrimidin-4-yl)pyrimidin-4-amine
CID 56605349
6-chloro-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 61278965
6-chloro-N-(2-methylbutyl)pyrimidin-4-amine
CID 62693783

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine?
The IUPAC name of 6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine (CID 130791788) is 6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine?
The canonical SMILES for 6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine is CN(C)C1(CNc2cc(Cl)ncn2)CC1.
What is the InChIKey of 6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine?
The InChIKey is RNCVMIHBBSXXBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4/c1-15(2)10(3-4-10)6-12-9-5-8(11)13-7-14-9/h5,7H,3-4,6H2,1-2H3,(H,12,13,14).
What are the key properties of 6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine?
6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine has a molecular weight of 226.71 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[[1-(dimethylamino)cyclopropyl]methyl]pyrimidin-4-amine is sourced from PubChem (CID 130791788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).