N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine

C14H29N3 — CID 114277183

IUPACN,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine
SMILESCCCCN(CCCC)C1=NCC(C)(C)CN1
InChIInChI=1S/C14H29N3/c1-5-7-9-17(10-8-6-2)13-15-11-14(3,4)12-16-13/h5-12H2,1-4H3,(H,15,16)
InChIKeyHKIOTKBTCFKSSN-UHFFFAOYSA-N
MW239.41 g/mol
LogP2.87
Rot. Bonds6

About N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine

N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine (PubChem CID 114277183) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine.

Molecular Properties

Compound NameN,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine
PubChem CID114277183
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine
SMILESCCCCN(CCCC)C1=NCC(C)(C)CN1
InChIInChI=1S/C14H29N3/c1-5-7-9-17(10-8-6-2)13-15-11-14(3,4)12-16-13/h5-12H2,1-4H3,(H,15,16)
InChIKeyHKIOTKBTCFKSSN-UHFFFAOYSA-N
XLogP2.87
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5,5-Dimethyl-1,4,5,6-tetrahydropyrimidin-2-amine
CID 12052711
[Butylamino(methylamino)methylidene]-dimethylazanium
CID 102337415
N-(2,2-difluoroethyl)-N,5,5-trimethyl-4,6-dihydro-1H-pyrimidin-2-amine
CID 130513083
N-(2-fluoroethyl)-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine
CID 130513113
N-(3-fluoropropyl)-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine
CID 130513115
2-(Ethylamino)-1,1-dimethyl-1,4,5,6-tetrahydropyrimidin-1-ium chloride
CID 15884328
N-ethyl-1,1-dimethyl-5,6-dihydro-4H-pyrimidin-1-ium-2-amine
CID 3290336
[1-[3-(ethylamino)propyl]-5,6-dihydro-4H-pyrimidin-2-yl]cyanamide
CID 18340112
1-methyl-N-(2-methylpropyl)-5,6-dihydro-4H-pyrimidin-2-amine
CID 20622495
1-(3,3-Dimethylbutyl)-1,2,3-trimethylguanidine
CID 20755638
1,2,3-Triethyl-1-propylguanidine
CID 23281967
1,2-Bis(2,2-dimethylpropyl)guanidine
CID 44238975

Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine?
The IUPAC name of N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine (CID 114277183) is N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine.
What is the SMILES notation for N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine?
The canonical SMILES for N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine is CCCCN(CCCC)C1=NCC(C)(C)CN1.
What is the InChIKey of N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine?
The InChIKey is HKIOTKBTCFKSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-5-7-9-17(10-8-6-2)13-15-11-14(3,4)12-16-13/h5-12H2,1-4H3,(H,15,16).
What are the key properties of N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine?
N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine has a molecular weight of 239.41 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-5,5-dimethyl-4,6-dihydro-1H-pyrimidin-2-amine is sourced from PubChem (CID 114277183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).